Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C13H17NO/c15-13(11-7-3-1-4-8-11)14-12-9-5-2-6-10-12/h2,5-6,9-11H,1,3-4,7-8H2,(H,14,15)
SMILES O=C(C1CCCCC1)Nc1ccccc1
InChI Key AZTGEJBZSFKULT-UHFFFAOYSA-N
Molecular Formula C13H17NO
Exact Mass 203.280 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AZTGEJBZSFKULT-UHFFFAOYSA-N/NMR/13C/CDCl3/75.1
License URL
Source https://www.chemotion-repository.net/inchikey/AZTGEJBZSFKULT-UHFFFAOYSA-N/NMR/13C/CDCl3/75.1
Version
Author Tim Wezeman
Maintainer Chemotion Repository
Language english
MetadataPublished 2014-08-13
Related Molecule
  • N-phenylcyclohexanecarboxamide
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEMBL1562513 chembl
    1300190 surechembl
    257030 pubchem
    VUZQOX CCDC
    Molport-002-826-513 molport
    The data in this table is sourced from UniChem at EBI.